BRN 4898413
TL;DR: BRN 4898413 (CAS 139032-30-7) is a chemical compound with molecular formula C34H28N6O3S and molecular weight 600.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3E)-1-(morpholin-4-ylmethyl)-3-[[5-[(4-phenoxyphenyl)diazenyl]-4-phenyl-1,3-thiazol-2-yl]imino]indol-2-one
Also Known As: 2H-Indol-2-one, 1,3-dihydro-1-(4-morpholinylmethyl)-3-((5-((4-phenoxyphenyl)azo)-4-phenyl-2-thiazolyl)imino)-, BRN 4898413
| Molecular Formula | C34H28N6O3S |
|---|---|
| Molecular Weight | 600.19 g/mol |
| LogP | 7.7749 |
| Topological Polar Surface Area | 91.98 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 600.19434 |
| Heavy Atoms | 44 |
| Complexity | 1817.3538 |
Chemical Identifiers
| CAS Number | 139032-30-7 |
|---|---|
| SMILES | C1COCCN1CN2C3=CC=CC=C3/C(=N\C4=NC(=C(S4)N=NC5=CC=C(C=C5)OC6=CC=CC=C6)C7=CC=CC=C7)/C2=O |
Product Overview
BRN 4898413 (CAS 139032-30-7), with molecular formula C34H28N6O3S and molecular weight 600.19 g/mol. IUPAC: (3E)-1-(morpholin-4-ylmethyl)-3-[[5-[(4-phenoxyphenyl)diazenyl]-4-phenyl-1,3-thiazol-2-yl]imino]indol-2-one.
Chemical Property Profile of BRN 4898413
Property Insights of BRN 4898413
The XLogP value of 7.7749 indicates that BRN 4898413 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.98 Ų falls within the moderate polarity range, balancing permeability and solubility for BRN 4898413. Following Lipinski's Rule of Five, BRN 4898413 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BRN 4898413?
The CAS number of BRN 4898413 is 139032-30-7.
What is the molecular formula of BRN 4898413?
The molecular formula of BRN 4898413 is C34H28N6O3S.
What is the molecular weight of BRN 4898413?
The molecular weight of BRN 4898413 is 600.19 g/mol.
Where can I buy BRN 4898413?
You can request a quote for BRN 4898413 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BRN 4898413?
Yes, KEHONG BIO provides custom synthesis services for BRN 4898413 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.